Package chemaxon.clustering
package chemaxon.clustering
Provides classes for clustering.
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ClassDescriptionCommon superclass for JKlustor tools.Compares two sets of objects (like compound libraries) using diversity and dissimilarity calculations.Performs variable-length Jarvis-Patrick clustering based on binary fingerprints (bits strings) and/or other data stored in a database table or a file.Compares two sets of objects (like compound libraries) using diversity and dissimilarity calculations.Uses Ward's minimum variance method for clustering molecules based on molecular fingerprints or other descriptors.